[Wien] hi
Dr. B.R.Sahu
sahu at matter3.ph.utexas.edu
Mon Aug 25 16:19:05 CEST 2003
Dear Prof Blaha
Here are some of the job steps for:
lapw1 -up -p:
longhorn1(1) 12.5u 0.1s 0:26 48% 337+54579k 0+0io 60pf+0w
lapw1 -dn -p:
longhorn1(1) 12.9u 0.1s 0:27 47% 339+54719k 0+0io 48pf+0w
as we can see the the actual cpu time(about 13 seconds) and time required
to finish the lapw1 steps(about 30 seconds) are reasonable.
I indeed had put -xf in runsp_lapw script and not in lapwso script and in
the case.day file I get:
lapwso:
if ( -e K2.scfso ) rm K2.scfso
if ( -so == -so ) then
set errin=K2.inso
if ( ! -e K2.inso || -z K2.inso ) goto error_input
set date = `date +"(%T)"`
date +(%T)
printf > %s\t%s lapwso -up -p (07:51:57)
../w2k/x lapwso -up -p
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
STOP LAPWSO END
Subscript out of range.
if ( 0 ) goto error
grep -v \[ K2.dayfile
mv .tmp K2.dayfile
if ( -e lapwso.error && ! -z lapwso.error ) goto error
goto error
if ( -e uplapwso.error && ! -z uplapwso.error ) goto error
if ( -e dnlapwso.error && ! -z dnlapwso.error ) goto error
if ( lapwso == ) goto stop
printf \n> stop error\n
exit 1
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